EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H16N2O3 |
| Net Charge | 0 |
| Average Mass | 296.326 |
| Monoisotopic Mass | 296.11609 |
| SMILES | COC1=CC(=C2C=C(c3ccc(OC)cc3)NN2)C(=O)C=C1 |
| InChI | InChI=1S/C17H16N2O3/c1-21-12-5-3-11(4-6-12)15-10-16(19-18-15)14-9-13(22-2)7-8-17(14)20/h3-10,18-19H,1-2H3 |
| InChIKey | GOGNYRZAHFTUFH-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-methoxy-6-[5-(4-methoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-1-cyclohexa-2,4-dienone (CHEBI:116432) is a quinomethanes (CHEBI:52404) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27886 | LINCS |